3-(4-ethoxybenzyl)-4-methoxymethyloxybenzoic acid methylester | 882662-53-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-(4-ethoxybenzyl)-4-methoxymethyloxybenzoic acid methylester
• 英文别名: 3-(4-Ethoxybenzyl)-4-methoxymethyloxybenzoic acid methylester；methyl 3-[(4-ethoxyphenyl)methyl]-4-(methoxymethoxy)benzoate
• CAS: 882662-53-5
• 化学式: C₁₉H₂₂O₅
• 分子量: 330.381
• InChiKey: BNZXGPOFSSYPGU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  24
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  3-(4-ethoxybenzyl)-4-methoxymethyloxybenzoic acid methylester 、 甲基膦酸二乙酯 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 1.0h， 生成 {2-[3-(4-ethoxybenzyl)-4-hydroxyphenyl]-2-oxoethyl}phosphonic acid diethylester
  参考文献：
  名称：

  EP1813620

  摘要：

  公开号：

文献信息

• Phosphonic Acid Derivatives and the Treating Agents of Diseases Related Hyperphosphatemia
  申请人：Tomiyama Hiroshi

  公开号：US20080119441A1

  公开（公告）日：2008-05-22

  This invention related to a series of new phosphonic acid derivatives having anti-hyperphosphatemia activity. (I) [wherein: A is selected from —(CH 2 ) n —, —CO—, —(CH 2 ) n —CO—(CH 2 ) m —, —(CH 2 ) n —CS—(CH 2 ) m — or branched alkylene group. B ring and C ring are selected from benzene ring, naphthalene ring, azulene ring or, heterocycle or fused heterocycle. D is —(CH 2 ) (n+1) —, —(CH2)-O—(CH 2 ) m —, —(CH 2 )—S(O) o —(CH 2 ) m —, —CF 3 or —(CH 2 ) n —NR 10 —(CH 2 ) m — (wherein: D ring is connected with the carbon atom composing C ring.) E is selected from oxygen atom or sulfur atom. P is phosphine atom. R 1 ˜R 7 (wherein R 1 and R 2 , R 4 and R 5 are joined together with neighbored carbon atom to form 5˜7 membered saturated or unsaturated hydrocarbon ring, or 5˜6 membered fused heterocycle. R 1 , R 2 and R 3 are not hydrogen atom if B ring is benzene ring.) may be the same or different and are substituents. R 8 and R 9 are may be the same or different and are substituents. R 10 is alkyl group. n and m are 0-10. o is 0-2.

  本发明涉及一系列具有抗高磷血症活性的新磷酸衍生物(I) [其中：A选自—(CH2)n—、—CO—、—(CH2)n—CO—(CH2)m—、—(CH2)n—CS—(CH2)m—或支链烷基。B环和C环选自苯环、萘环、蓝环或杂环或融合杂环。D选自—(CH2)(n+1)—、—(CH2)-O—(CH2)m—、—(CH2)—S(O)o—(CH2)m—、—CF3或—(CH2)n—NR10—(CH2)m—（其中：D环与组成C环的碳原子相连）。E选自氧原子或硫原子。P为磷原子。R1˜R7（其中R1和R2，R4和R5与相邻的碳原子结合形成5˜7个成员的饱和或不饱和碳氢化合物环，或5˜6个成员的融合杂环。如果B环为苯环，则R1、R2和R3不是氢原子。）可能相同或不同，并且是取代基。R8和R9可能相同或不同，并且是取代基。R10是烷基。n和m为0-10。o为0-2。
• Phosphonic acid derivatives and the treating agents of diseases related hyperphosphatemia
  申请人：Kotobuki Pharmaceutical Co., Ltd.

  公开号：US07691898B2

  公开（公告）日：2010-04-06

  This invention related to a series of new phosphonic acid derivatives having anti-hyperphosphatemia activity. wherein: A is selected from —(CH2)n—, —CO—, —(CH2)n—CO—(CH2)m—, —(CH2)n—CS—(CH2)m— or a branched alkylene group, B ring and C ring are selected from a benzene ring, naphthalene ring, azulene ring or, heterocycle or fused heterocycle compound, D is —(CH2)(n+1)—, —(CH2)—O—(CH2)m—, —(CH2)—S(O)o—(CH2)m—, —CF3 or —(CH2)n—NR10—(CH2)m— wherein a D ring is connected with the carbon atom composing the C ring, E is selected from an oxygen atom or a sulfur atom, P is a phosphine atom, R1˜R7, wherein R1 and R2, R4 and R5 are joined together with neighbored carbon atom to form 5˜7 membered saturated or unsaturated hydrocarbon ring, or 5˜6 membered fused heterocycle, R1, R2 and R3 are not a hydrogen atom if the B ring is a benzene ring and may be the same or different and are substituents, R8 and R9 are may be the same or different and are substituents, R10 is an alkyl group, n and m are 0-10 and o is 0-2.

  本发明涉及一系列具有抗高磷血症活性的新磷酸衍生物，其中：A选自—(CH2)n—、—CO—、—(CH2)n—CO—(CH2)m—、—(CH2)n—CS—(CH2)m—或支链烷基，B环和C环选自苯环、萘环、蓝环或杂环或融合的杂环化合物，D为—(CH2)(n+1)—、—(CH2)—O—(CH2)m—、—(CH2)—S(O)o—(CH2)m—、—CF3或—(CH2)n—NR10—(CH2)m—，其中D环与组成C环的碳原子相连，E选自氧原子或硫原子，P为磷化物原子，R1˜R7，其中R1和R2、R4和R5与相邻的碳原子连接形成5˜7个成员的饱和或不饱和碳氢化合物环，或5˜6个成员的融合杂环，如果B环是苯环，则R1、R2和R3不是氢原子，可以相同或不同，是取代基，R8和R9可以相同或不同，是取代基，R10是烷基，n和m为0-10，o为0-2。
• EP1813620
  申请人：——

  公开号：——

  公开（公告）日：——